[5-[(E)-2-cyano-3-(diethylamino)-3-oxidanylidene-prop-1-enyl]-3-nitro-2-oxidanyl-phenyl] N-tert-butylcarbamate

Systemtic Name: [5-[(E)-2-cyano-3-(diethylamino)-3-oxidanylidene-prop-1-enyl]-3-nitro-2-oxidanyl-phenyl] N-tert-butylcarbamate Openeye Name: [5-[(E)-2-cyano-3-(diethylamino)-3-oxo-prop-1-enyl]-2-hydroxy-3-nitro-phenyl] N-tert-butylcarbamate CAS Name: N-tert-butylcarbamic acid [5-[(E)-2-cyano-3-(diethylamino)-3-oxoprop-1-enyl]-2-hydroxy-3-nitrophenyl] ester IUPAC Name: [5-[(E)-2-cyano-3-(diethylamino)-3-oxoprop-1-enyl]-2-hydroxy-3-nitrophenyl] N-tert-butylcarbamate Traditional Name: N-tert-butylcarbamic acid [5-[(E)-2-cyano-3-(diethylamino)-3-keto-prop-1-enyl]-2-hydroxy-3-nitro-phenyl] ester Formula: C19H24N4O6 MolecularWeight: 404.41706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(=CC1=CC(=C(C(=C1)OC(=O)NC(C)(C)C)O)[N+](=O)[O-])C#N

Isomeric SMILES

CCN(CC)C(=O)/C(=C/C1=CC(=C(C(=C1)OC(=O)NC(C)(C)C)O)[N+](=O)[O-])/C#N

InChI

InChI=1S/C19H24N4O6/c1-6-22(7-2)17(25)13(11-20)8-12-9-14(23(27)28)16(24)15(10-12)29-18(26)21-19(3,4)5/h8-10,24H,6-7H2,1-5H3,(H,21,26)/b13-8+